#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i9y s GLU 18 N 0.00 1.74 0.41 -2.82 0.41 -1.26 -5.14 118.70 112.04 2i9y s GLU 18 Ca 0.00 -1.82 -0.24 0.00 -0.41 0.00 0.00 54.97 52.49 2i9y s GLU 18 Cb 0.00 0.38 -0.09 0.00 -1.78 0.00 0.00 34.13 32.64 2i9y s GLU 18 CO 0.00 -0.68 1.10 0.00 -0.49 0.00 0.00 175.26 175.19 2i9y s ALA 19 N -3.39 3.09 0.48 5.21 0.00 -1.26 -4.92 121.76 120.96 2i9y s ALA 19 Ca 0.35 0.81 0.18 0.00 0.00 0.00 0.00 51.96 53.30 2i9y s ALA 19 Cb 0.02 -3.32 1.22 0.00 0.00 0.00 0.00 23.12 21.04 2i9y s ALA 19 CO 0.22 -0.36 2.07 0.77 0.00 0.00 0.00 175.76 178.46 2i9y h SER 20 N 2.49 0.00 0.29 0.00 0.02 -2.01 0.97 113.55 115.31 2i9y h SER 20 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2i9y h SER 20 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2i9y h SER 20 CO 0.62 0.11 -0.23 -1.54 -1.14 0.00 0.00 176.83 174.65 2i9y n SER 21 N -4.23 0.87 -1.66 3.07 3.41 -1.26 -4.92 113.62 108.90 2i9y n SER 21 Ca -0.03 -0.77 -0.21 0.00 -0.26 0.00 0.00 58.87 57.60 2i9y n SER 21 Cb 0.19 0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 64.15 2i9y n SER 21 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2i9y n LEU 22 N -0.77 -1.55 -4.63 1.04 4.77 0.34 -4.78 117.00 111.42 2i9y n LEU 22 Ca 0.12 0.46 -0.41 0.00 -0.03 0.00 0.00 56.01 56.15 2i9y n LEU 22 Cb 0.33 -2.85 -0.06 0.00 -2.33 0.00 0.00 43.42 38.51 2i9y n LEU 22 CO 0.26 -1.00 0.42 -0.69 -1.33 0.00 0.00 177.39 175.06 2i9y s VAL 23 N -2.79 4.97 0.16 4.08 1.01 -1.26 -0.72 120.40 125.84 2i9y s VAL 23 Ca 0.00 1.19 0.09 0.00 0.00 0.00 0.00 61.98 63.26 2i9y s VAL 23 Cb 0.00 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2i9y s VAL 23 CO 0.00 0.02 -0.19 -0.83 0.00 0.00 0.00 175.10 174.10 2i9y s GLY 24 N 1.43 1.39 -0.03 4.51 0.00 0.10 -4.68 107.32 110.05 2i9y s GLY 24 Ca 0.27 -1.46 -0.12 0.00 0.00 0.00 0.00 44.72 43.42 2i9y s GLY 24 CO 0.08 -1.50 0.26 -1.59 0.00 0.00 0.00 173.10 170.36 2i9y s LYS 25 N -2.62 0.56 -0.01 2.90 0.00 -1.26 -0.02 119.74 119.29 2i9y s LYS 25 Ca 0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 55.97 55.95 2i9y s LYS 25 Cb -0.07 0.25 -0.00 0.00 0.00 0.00 0.00 37.83 38.01 2i9y s LYS 25 CO 0.06 -0.14 0.03 -1.17 0.00 0.00 0.00 175.35 174.13 2i9y s LEU 26 N -1.09 1.92 -0.01 2.77 0.20 0.10 -4.98 118.68 117.59 2i9y s LEU 26 Ca -0.12 -0.07 0.05 0.00 0.69 0.00 0.00 54.13 54.68 2i9y s LEU 26 Cb -0.05 0.16 -0.01 0.00 -0.43 0.00 0.00 46.19 45.86 2i9y s LEU 26 CO 0.03 -0.10 -0.17 -0.70 -0.29 0.00 0.00 176.35 175.12 2i9y s GLU 27 N -0.41 1.36 0.14 1.98 2.12 -1.26 -0.05 118.70 122.57 2i9y s GLU 27 Ca -0.05 -0.60 -0.14 0.00 0.36 0.00 0.00 54.97 54.54 2i9y s GLU 27 Cb -0.03 -1.31 0.02 0.00 0.26 0.00 0.00 34.13 33.07 2i9y s GLU 27 CO -0.00 0.36 0.38 -0.08 -0.54 0.00 0.00 175.26 175.38 2i9y s THR 28 N -0.40 0.07 -0.05 -1.70 -1.32 -0.59 -5.02 115.64 106.63 2i9y s THR 28 Ca 0.06 -0.85 0.02 0.00 -1.21 0.00 0.00 61.69 59.72 2i9y s THR 28 Cb -0.06 -1.40 0.01 0.00 -1.51 0.00 0.00 72.50 69.53 2i9y s THR 28 CO -0.01 -0.32 -0.10 1.51 -2.21 0.00 0.00 174.62 173.49 2i9y s ASP 29 N -2.86 1.48 -0.10 8.08 -4.77 -1.26 -0.12 116.67 117.12 2i9y s ASP 29 Ca 0.07 -0.24 0.03 0.00 -3.30 0.00 0.00 52.55 49.11 2i9y s ASP 29 Cb 0.02 -0.59 -0.01 0.00 -1.09 0.00 0.00 42.92 41.25 2i9y s ASP 29 CO -0.08 0.04 -0.20 -0.69 0.70 0.00 0.00 175.17 174.94 2i9y s VAL 30 N 0.52 2.44 -0.05 2.11 1.01 -0.66 -4.95 120.40 120.83 2i9y s VAL 30 Ca -0.10 -0.90 -0.21 0.00 0.00 0.00 0.00 61.98 60.78 2i9y s VAL 30 Cb -0.13 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.24 2i9y s VAL 30 CO 0.02 0.55 0.60 -1.83 0.00 0.00 0.00 175.10 174.44 2i9y s GLU 31 N 0.15 4.36 0.12 2.72 4.04 -1.26 -0.65 118.70 128.17 2i9y s GLU 31 Ca -0.11 0.72 0.08 0.00 0.04 0.00 0.00 54.97 55.70 2i9y s GLU 31 Cb -0.16 -3.39 -0.04 0.00 0.02 0.00 0.00 34.13 30.56 2i9y s GLU 31 CO 0.06 0.24 -0.21 0.96 -1.84 0.00 0.00 175.26 174.47 2i9y s ILE 32 N 0.27 1.78 -0.41 1.83 -4.36 0.80 -4.98 121.20 116.12 2i9y s ILE 32 Ca 0.32 -1.65 0.26 0.00 -0.26 0.00 0.00 60.65 59.31 2i9y s ILE 32 Cb -0.17 -1.66 0.33 0.00 1.25 0.00 0.00 42.46 42.20 2i9y s ILE 32 CO 0.16 -0.11 1.74 0.11 0.24 0.00 0.00 174.94 177.07 2i9y h LYS 33 N 3.85 0.00 -6.88 0.37 1.57 -1.83 -0.99 116.57 112.67 2i9y h LYS 33 Ca -0.46 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.76 2i9y h LYS 33 Cb 1.19 0.00 0.14 0.00 0.08 0.00 0.00 32.23 33.64 2i9y h LYS 33 CO 0.42 0.00 0.36 0.00 -0.57 0.00 0.00 179.45 179.66 2i9y n ALA 34 N -1.99 0.84 -2.71 3.86 0.00 -1.26 -4.32 120.51 114.94 2i9y n ALA 34 Ca 0.04 0.12 -0.38 0.00 0.00 0.00 0.00 53.44 53.21 2i9y n ALA 34 Cb 0.43 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.61 2i9y n ALA 34 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2i9y s SER 35 N -0.95 6.77 0.17 0.00 0.01 -1.26 -2.16 113.70 116.28 2i9y s SER 35 Ca 0.70 0.92 -0.10 0.00 1.31 0.00 0.00 55.95 58.79 2i9y s SER 35 Cb -0.45 -2.32 0.06 0.00 0.21 0.00 0.00 66.02 63.51 2i9y s SER 35 CO 0.51 -0.03 1.63 0.00 0.41 0.00 0.00 173.24 175.77 2i9y h ALA 36 N 6.69 0.79 -0.30 1.44 0.00 -1.93 -2.12 119.26 123.83 2i9y h ALA 36 Ca -0.41 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.07 2i9y h ALA 36 Cb 1.18 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2i9y h ALA 36 CO 0.75 0.63 -0.31 -0.44 0.00 0.00 0.00 179.25 179.89 2i9y h ASP 37 N 0.93 0.65 -0.87 0.00 3.32 -1.95 -2.62 116.42 115.89 2i9y h ASP 37 Ca 0.17 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 2i9y h ASP 37 Cb 0.55 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.88 2i9y h ASP 37 CO 0.03 0.92 0.49 0.50 -1.72 0.00 0.00 179.24 179.46 2i9y h LYS 38 N 0.54 1.20 -0.34 3.56 3.64 -1.89 -0.84 116.57 122.45 2i9y h LYS 38 Ca 0.06 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2i9y h LYS 38 Cb 0.80 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 2i9y h LYS 38 CO 0.07 0.87 0.17 0.35 -2.27 0.00 0.00 179.45 178.63 2i9y h PHE 39 N 1.21 0.48 -0.99 1.91 3.04 -1.13 -0.83 116.94 120.63 2i9y h PHE 39 Ca 0.31 -0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.29 2i9y h PHE 39 Cb 0.00 -0.15 -0.06 0.00 2.56 0.00 0.00 35.95 38.30 2i9y h PHE 39 CO 0.01 0.41 0.64 1.25 -2.02 0.00 0.00 178.31 178.60 2i9y h HIS 40 N 0.41 1.19 0.04 0.41 2.76 -0.99 0.19 115.15 119.16 2i9y h HIS 40 Ca 0.12 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2i9y h HIS 40 Cb 0.11 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 28.68 2i9y h HIS 40 CO -0.02 0.64 -0.02 0.45 -1.30 0.00 0.00 177.93 177.69 2i9y h HIS 41 N 1.19 -0.05 0.00 5.26 3.86 -0.73 -2.80 115.15 121.88 2i9y h HIS 41 Ca 0.41 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.58 2i9y h HIS 41 Cb 0.10 0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 2i9y h HIS 41 CO -0.00 0.44 -0.21 0.00 0.86 0.00 0.00 177.93 179.02 2i9y h MET 42 N -0.56 0.00 0.00 2.45 -0.00 -0.92 -2.30 114.93 113.59 2i9y h MET 42 Ca -0.01 0.00 -0.08 0.00 -0.00 0.00 0.00 59.70 59.62 2i9y h MET 42 Cb 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.10 2i9y h MET 42 CO 0.01 0.21 -0.37 0.35 -0.00 0.00 0.00 176.91 177.11 2i9y h PHE 43 N 0.00 0.00 0.00 -0.10 3.57 -0.70 -2.87 116.94 116.83 2i9y h PHE 43 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2i9y h PHE 43 Cb 0.89 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.63 2i9y h PHE 43 CO 0.00 0.37 -0.25 0.00 -2.23 0.00 0.00 178.31 176.19 2i9y h ALA 44 N 1.63 0.84 -2.39 2.41 0.00 -1.18 -3.35 119.26 117.23 2i9y h ALA 44 Ca -0.00 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.26 2i9y h ALA 44 Cb 1.10 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 18.50 2i9y h ALA 44 CO 0.05 0.00 -0.35 0.41 0.00 0.00 0.00 179.25 179.35 2i9y n GLY 45 N 1.26 4.65 3.77 0.00 0.00 -0.90 -5.08 105.19 108.89 2i9y n GLY 45 Ca 0.04 -2.71 -0.39 0.00 0.00 0.00 0.00 46.02 42.96 2i9y n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i9y s LYS 46 N -2.22 3.97 -0.15 1.61 1.02 -1.24 -4.83 119.74 117.88 2i9y s LYS 46 Ca 0.35 1.95 -0.34 0.00 0.02 0.00 0.00 55.97 57.95 2i9y s LYS 46 Cb 0.08 -2.67 -0.11 0.00 -0.52 0.00 0.00 37.83 34.61 2i9y s LYS 46 CO -0.04 -0.43 1.98 -2.30 -0.92 0.00 0.00 175.35 173.64 2i9y n PRO 47 N 0.01 1.95 -3.00 -1.68 -0.02 -1.26 -4.88 135.00 126.12 2i9y n PRO 47 Ca 0.05 0.68 -0.44 0.00 -2.02 0.00 0.00 63.50 61.76 2i9y n PRO 47 Cb 0.46 -2.68 -0.00 0.00 -0.02 0.00 0.00 33.50 31.25 2i9y n PRO 47 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2i9y s HIS 48 N 5.17 3.56 -0.26 6.00 2.46 -1.26 -4.65 115.29 126.32 2i9y s HIS 48 Ca 0.97 -2.13 -0.02 0.00 0.47 0.00 0.00 55.06 54.35 2i9y s HIS 48 Cb -0.68 -4.24 0.00 0.00 -0.13 0.00 0.00 32.58 27.53 2i9y s HIS 48 CO 0.49 -1.34 0.05 1.58 -2.47 0.00 0.00 174.74 173.06 2i9y n HIS 49 N 5.34 -3.14 -4.31 3.88 -0.00 -1.26 -5.05 115.22 110.67 2i9y n HIS 49 Ca 0.33 1.38 -0.19 0.00 0.46 0.00 0.00 57.72 59.70 2i9y n HIS 49 Cb 0.43 -3.37 -0.11 0.00 -0.12 0.00 0.00 29.99 26.82 2i9y n HIS 49 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 2i9y s VAL 50 N -1.57 1.62 -0.36 3.57 -7.23 -1.26 -5.11 120.40 110.06 2i9y s VAL 50 Ca 0.02 -1.96 0.07 0.00 -1.81 0.00 0.00 61.98 58.30 2i9y s VAL 50 Cb -0.01 -1.82 0.19 0.00 0.56 0.00 0.00 36.38 35.31 2i9y s VAL 50 CO 0.63 -0.46 0.63 -0.55 -0.31 0.00 0.00 175.10 175.04 2i9y s SER 51 N -2.83 -1.53 0.01 4.85 0.15 -1.26 -5.00 113.70 108.08 2i9y s SER 51 Ca 0.16 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2i9y s SER 51 Cb -0.03 1.95 0.00 0.00 -1.71 0.00 0.00 66.02 66.23 2i9y s SER 51 CO 0.05 -0.21 0.00 1.17 1.20 0.00 0.00 173.24 175.45 2i9y n LYS 52 N 4.79 0.00 -2.79 5.44 4.81 -1.26 -5.06 118.16 124.10 2i9y n LYS 52 Ca 0.09 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.10 2i9y n LYS 52 Cb 0.56 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.58 2i9y n LYS 52 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2i9y s ALA 53 N -1.18 3.09 -0.18 3.14 0.00 -1.26 -4.87 121.76 120.51 2i9y s ALA 53 Ca 0.00 -2.33 -0.35 0.00 0.00 0.00 0.00 51.96 49.28 2i9y s ALA 53 Cb 0.00 -4.15 0.14 0.00 0.00 0.00 0.00 23.12 19.11 2i9y s ALA 53 CO 0.00 -3.13 1.32 -1.54 0.00 0.00 0.00 175.76 172.41 2i9y s SER 54 N 4.01 -0.06 0.27 0.00 1.04 -1.26 -5.13 113.70 112.57 2i9y s SER 54 Ca 0.34 -0.03 -0.30 0.00 0.48 0.00 0.00 55.95 56.44 2i9y s SER 54 Cb -0.06 0.08 -0.13 0.00 0.10 0.00 0.00 66.02 66.01 2i9y s SER 54 CO -0.04 -0.14 1.41 -0.81 0.98 0.00 0.00 173.24 174.64 2i9y n PRO 55 N -0.20 2.14 -1.47 4.02 -0.04 -1.26 -4.85 135.00 133.35 2i9y n PRO 55 Ca -0.01 0.76 -0.40 0.00 -0.04 0.00 0.00 63.50 63.81 2i9y n PRO 55 Cb 0.59 -2.42 -0.02 0.00 -0.04 0.00 0.00 33.50 31.62 2i9y n PRO 55 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2i9y n GLY 56 N 1.86 4.16 2.85 0.55 0.00 -1.26 -4.74 105.19 108.61 2i9y n GLY 56 Ca 0.10 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.32 2i9y n GLY 56 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2i9y s ASN 57 N 2.91 4.32 -0.26 1.61 2.47 -1.26 -5.09 114.94 119.64 2i9y s ASN 57 Ca 0.56 -1.92 -0.15 0.00 0.42 0.00 0.00 52.86 51.78 2i9y s ASN 57 Cb 0.15 -1.20 -0.04 0.00 -1.45 0.00 0.00 41.25 38.72 2i9y s ASN 57 CO -0.06 -0.39 0.37 -0.63 -3.72 0.00 0.00 177.10 172.66 2i9y s ILE 58 N 1.24 5.18 0.06 -5.21 1.01 -1.26 -5.05 121.20 117.17 2i9y s ILE 58 Ca 0.11 0.56 -0.27 0.00 0.00 0.00 0.00 60.65 61.05 2i9y s ILE 58 Cb -0.18 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 2i9y s ILE 58 CO -0.17 0.17 0.86 0.00 0.00 0.00 0.00 174.94 175.80 2i9y s GLN 59 N 1.99 4.58 0.40 2.79 -2.07 -1.26 -5.05 119.66 121.03 2i9y s GLN 59 Ca 0.15 1.25 0.06 0.00 -1.82 0.00 0.00 55.36 55.00 2i9y s GLN 59 Cb -0.16 -3.39 0.00 0.00 -1.09 0.00 0.00 33.01 28.38 2i9y s GLN 59 CO 0.10 0.20 0.55 0.20 -1.32 0.00 0.00 175.29 175.02 2i9y s GLY 60 N 0.14 1.75 0.00 2.60 0.00 -1.26 -4.56 107.32 106.00 2i9y s GLY 60 Ca 0.43 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.65 2i9y s GLY 60 CO 0.26 -1.36 0.00 0.00 0.00 0.00 0.00 173.10 172.00 2i9y s ASP 62 N 0.00 4.45 -0.43 0.00 2.15 -1.26 -5.03 116.67 116.54 2i9y s ASP 62 Ca 0.00 -1.92 -0.04 0.00 0.43 0.00 0.00 52.55 51.02 2i9y s ASP 62 Cb 0.00 -1.32 0.11 0.00 -0.30 0.00 0.00 42.92 41.42 2i9y s ASP 62 CO 0.00 -0.39 0.25 -0.22 -0.17 0.00 0.00 175.17 174.64 2i9y s LEU 63 N 1.20 5.37 -0.08 -1.34 0.20 -1.26 -4.95 118.68 117.82 2i9y s LEU 63 Ca 0.10 -2.03 -0.19 0.00 0.69 0.00 0.00 54.13 52.70 2i9y s LEU 63 Cb -0.18 -1.88 -0.04 0.00 -0.43 0.00 0.00 46.19 43.66 2i9y s LEU 63 CO -0.15 -0.58 0.51 -2.28 -0.29 0.00 0.00 176.35 173.56 2i9y s HIS 64 N 1.15 3.57 0.00 5.38 5.65 -1.26 -4.91 115.29 124.87 2i9y s HIS 64 Ca 0.08 0.98 0.00 0.00 0.25 0.00 0.00 55.06 56.37 2i9y s HIS 64 Cb -0.24 -2.56 0.00 0.00 -1.18 0.00 0.00 32.58 28.61 2i9y s HIS 64 CO -0.03 0.24 0.00 -1.91 -0.65 0.00 0.00 174.74 172.38 2i9y n GLU 65 N 3.34 0.00 0.00 2.88 2.13 -1.26 -5.11 120.64 122.62 2i9y n GLU 65 Ca -0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.75 2i9y n GLU 65 Cb 0.52 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.23 2i9y n GLU 65 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2i9y n GLY 66 N 0.00 1.99 3.37 8.31 0.00 -1.26 -3.59 105.19 114.01 2i9y n GLY 66 Ca 0.00 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2i9y n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2i9y s ASP 67 N -4.00 5.69 0.18 1.61 1.01 -1.26 -4.93 116.67 114.97 2i9y s ASP 67 Ca 0.00 -1.01 0.23 0.00 0.71 0.00 0.00 52.55 52.49 2i9y s ASP 67 Cb 0.00 -2.01 0.21 0.00 1.01 0.00 0.00 42.92 42.14 2i9y s ASP 67 CO 0.00 -0.38 1.24 -0.25 0.21 0.00 0.00 175.17 175.99 2i9y h TRP 68 N 8.41 0.00 0.00 4.23 2.91 -1.99 -3.47 115.95 126.04 2i9y h TRP 68 Ca -0.25 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.77 2i9y h TRP 68 Cb 1.10 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.75 2i9y h TRP 68 CO 0.57 0.00 0.00 0.41 -1.03 0.00 0.00 178.44 178.39 2i9y n GLY 69 N 1.26 0.74 5.27 2.65 0.00 -1.26 -4.57 105.19 109.28 2i9y n GLY 69 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2i9y n GLY 69 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2i9y n THR 70 N -2.07 0.00 -2.30 2.61 -1.04 -1.26 -4.79 114.28 105.42 2i9y n THR 70 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 2i9y n THR 70 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 2i9y n THR 70 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2i9y s VAL 71 N 0.00 3.87 0.00 12.58 0.11 -1.26 -1.57 120.40 134.13 2i9y s VAL 71 Ca 0.00 1.26 0.00 0.00 -2.93 0.00 0.00 61.98 60.31 2i9y s VAL 71 Cb 0.00 -3.81 0.00 0.00 -1.53 0.00 0.00 36.38 31.04 2i9y s VAL 71 CO 0.00 0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.39 2i9y n GLY 72 N 3.52 0.44 3.77 6.54 0.00 -0.22 -4.99 105.19 114.25 2i9y n GLY 72 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 2i9y n GLY 72 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i9y s SER 73 N -2.30 5.89 -0.14 1.61 0.15 -0.61 -4.61 113.70 113.69 2i9y s SER 73 Ca 0.00 2.25 -0.01 0.00 0.70 0.00 0.00 55.95 58.89 2i9y s SER 73 Cb 0.00 -2.59 0.04 0.00 -1.71 0.00 0.00 66.02 61.75 2i9y s SER 73 CO 0.00 -1.10 -0.05 -0.63 1.20 0.00 0.00 173.24 172.66 2i9y s ILE 74 N -1.66 0.97 0.09 6.45 1.01 -1.26 -0.48 121.20 126.33 2i9y s ILE 74 Ca 0.69 -0.44 0.08 0.00 0.00 0.00 0.00 60.65 60.97 2i9y s ILE 74 Cb -0.26 -1.12 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 2i9y s ILE 74 CO 0.31 0.19 -0.21 -0.69 0.00 0.00 0.00 174.94 174.55 2i9y s VAL 75 N 1.71 1.68 -0.07 2.92 1.01 -1.25 -5.06 120.40 121.34 2i9y s VAL 75 Ca 0.02 -1.47 0.03 0.00 0.00 0.00 0.00 61.98 60.56 2i9y s VAL 75 Cb -0.14 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.73 2i9y s VAL 75 CO -0.08 -0.02 -0.16 -0.36 0.00 0.00 0.00 175.10 174.48 2i9y s PHE 76 N -1.10 1.77 -0.23 5.22 0.08 -1.26 -3.89 117.98 118.56 2i9y s PHE 76 Ca 0.06 -0.67 -0.06 0.00 0.12 0.00 0.00 56.93 56.38 2i9y s PHE 76 Cb -0.10 -1.25 -0.02 0.00 -0.57 0.00 0.00 43.02 41.08 2i9y s PHE 76 CO 0.04 -0.31 0.03 -1.58 -0.10 0.00 0.00 175.22 173.30 2i9y s TRP 77 N 0.54 3.05 -0.15 0.36 0.52 -1.06 -4.93 118.94 117.27 2i9y s TRP 77 Ca -0.15 -0.53 -0.03 0.00 0.02 0.00 0.00 56.10 55.41 2i9y s TRP 77 Cb -0.16 -2.18 -0.03 0.00 -1.15 0.00 0.00 33.47 29.95 2i9y s TRP 77 CO 0.05 -0.36 -0.03 -0.80 0.02 0.00 0.00 176.95 175.82 2i9y s ASN 78 N 1.44 4.85 0.19 2.95 -0.87 -1.26 -0.46 114.94 121.77 2i9y s ASN 78 Ca 0.05 -0.09 -0.18 0.00 -1.57 0.00 0.00 52.86 51.07 2i9y s ASN 78 Cb -0.15 -1.73 0.03 0.00 -0.02 0.00 0.00 41.25 39.39 2i9y s ASN 78 CO 0.02 0.20 0.53 -0.72 -2.57 0.00 0.00 177.10 174.55 2i9y s TYR 79 N 0.19 -0.18 -0.25 2.20 1.13 -0.19 -5.01 117.35 115.25 2i9y s TYR 79 Ca -0.02 -0.15 -0.07 0.00 -1.41 0.00 0.00 57.07 55.42 2i9y s TYR 79 Cb -0.14 0.41 -0.03 0.00 -1.10 0.00 0.00 41.96 41.11 2i9y s TYR 79 CO 0.03 -0.90 0.07 0.08 -2.51 0.00 0.00 175.55 172.31 2i9y s VAL 80 N -3.85 4.28 -0.03 -3.49 1.01 -1.26 0.18 120.40 117.24 2i9y s VAL 80 Ca 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 2i9y s VAL 80 Cb -0.01 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.38 2i9y s VAL 80 CO -0.04 0.32 0.05 -2.28 0.00 0.00 0.00 175.10 173.15 2i9y s HIS 81 N 1.61 -0.01 -1.49 5.22 5.04 0.69 -4.75 115.29 121.60 2i9y s HIS 81 Ca 0.06 0.18 0.00 0.00 -1.54 0.00 0.00 55.06 53.76 2i9y s HIS 81 Cb -0.15 -0.19 0.00 0.00 0.04 0.00 0.00 32.58 32.28 2i9y s HIS 81 CO 0.03 -0.10 0.00 -0.25 -2.34 0.00 0.00 174.74 172.09 2i9y n ASP 82 N 4.10 -4.91 0.00 9.88 8.00 -1.26 -1.92 116.55 130.44 2i9y n ASP 82 Ca -0.26 0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.31 2i9y n ASP 82 Cb 0.51 -3.99 0.00 0.00 -0.02 0.00 0.00 41.12 37.63 2i9y n ASP 82 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2i9y n GLY 83 N -1.00 2.92 3.89 0.44 0.00 -1.26 -5.01 105.19 105.17 2i9y n GLY 83 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 2i9y n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2i9y s GLU 84 N -0.04 3.64 -0.34 1.61 8.01 -0.81 -5.03 118.70 125.75 2i9y s GLU 84 Ca 0.00 -0.04 -0.28 0.00 0.01 0.00 0.00 54.97 54.66 2i9y s GLU 84 Cb 0.00 -2.86 0.02 0.00 -4.31 0.00 0.00 34.13 26.98 2i9y s GLU 84 CO 0.00 0.47 1.04 0.00 0.01 0.00 0.00 175.26 176.79 2i9y s ALA 85 N -1.63 3.46 0.07 5.21 0.00 -1.26 -0.22 121.76 127.40 2i9y s ALA 85 Ca 0.40 -0.16 0.09 0.00 0.00 0.00 0.00 51.96 52.30 2i9y s ALA 85 Cb -0.12 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.32 2i9y s ALA 85 CO 0.23 -1.54 -0.25 0.15 0.00 0.00 0.00 175.76 174.36 2i9y s LYS 86 N 3.64 1.73 0.12 0.00 1.02 0.13 -4.96 119.74 121.42 2i9y s LYS 86 Ca 0.44 -1.16 0.08 0.00 0.02 0.00 0.00 55.97 55.34 2i9y s LYS 86 Cb -0.12 -2.00 -0.04 0.00 -0.52 0.00 0.00 37.83 35.16 2i9y s LYS 86 CO 0.17 0.50 -0.19 0.08 -0.92 0.00 0.00 175.35 174.99 2i9y s VAL 87 N -0.92 1.66 -0.31 3.17 1.01 -1.26 -1.02 120.40 122.74 2i9y s VAL 87 Ca 0.13 -1.66 -0.07 0.00 0.00 0.00 0.00 61.98 60.37 2i9y s VAL 87 Cb -0.10 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.68 2i9y s VAL 87 CO 0.04 -0.19 0.10 0.00 0.00 0.00 0.00 175.10 175.05 2i9y s ALA 88 N -1.56 3.10 -0.17 5.51 0.00 0.39 -4.94 121.76 124.10 2i9y s ALA 88 Ca 0.09 -1.51 -0.04 0.00 0.00 0.00 0.00 51.96 50.50 2i9y s ALA 88 Cb -0.08 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 2i9y s ALA 88 CO 0.05 -1.02 -0.03 0.15 0.00 0.00 0.00 175.76 174.91 2i9y s LYS 89 N 1.50 3.66 0.03 0.00 1.02 -1.26 -2.57 119.74 122.12 2i9y s LYS 89 Ca 0.02 -0.52 -0.20 0.00 0.02 0.00 0.00 55.97 55.30 2i9y s LYS 89 Cb -0.18 -2.96 0.04 0.00 -0.52 0.00 0.00 37.83 34.21 2i9y s LYS 89 CO 0.03 0.19 0.45 -1.83 -0.92 0.00 0.00 175.35 173.26 2i9y s GLU 90 N 0.52 0.93 -0.05 1.68 -1.05 -1.25 -3.70 118.70 115.77 2i9y s GLU 90 Ca -0.03 -0.27 -0.01 0.00 -0.15 0.00 0.00 54.97 54.51 2i9y s GLU 90 Cb -0.14 0.42 0.03 0.00 -0.44 0.00 0.00 34.13 34.00 2i9y s GLU 90 CO 0.03 -0.32 0.01 0.50 0.95 0.00 0.00 175.26 176.43 2i9y s ARG 91 N -2.27 0.42 0.02 -4.83 3.00 0.13 -3.75 118.95 111.67 2i9y s ARG 91 Ca -0.06 0.13 -0.30 0.00 -1.00 0.00 0.00 55.73 54.49 2i9y s ARG 91 Cb -0.01 -0.75 -0.07 0.00 0.00 0.00 0.00 34.95 34.11 2i9y s ARG 91 CO -0.01 -0.25 1.68 0.42 0.00 0.00 0.00 175.30 177.15 2i9y s ILE 92 N 1.67 3.25 -0.22 4.11 1.01 0.37 0.06 121.20 131.45 2i9y s ILE 92 Ca -0.00 0.53 -0.00 0.00 0.00 0.00 0.00 60.65 61.17 2i9y s ILE 92 Cb -0.13 -3.34 -0.13 0.00 0.01 0.00 0.00 42.46 38.87 2i9y s ILE 92 CO -0.03 -0.02 -0.21 1.21 0.00 0.00 0.00 174.94 175.89 2i9y n GLU 93 N 6.35 0.53 -3.80 2.79 4.07 0.65 -1.06 120.64 130.17 2i9y n GLU 93 Ca 0.17 0.14 -0.13 0.00 -0.06 0.00 0.00 57.16 57.28 2i9y n GLU 93 Cb 0.41 -1.41 -0.10 0.00 -0.06 0.00 0.00 31.44 30.29 2i9y n GLU 93 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2i9y s ALA 94 N -2.43 -0.61 -0.10 4.31 0.00 -1.16 -4.84 121.76 116.93 2i9y s ALA 94 Ca -0.29 0.38 -0.09 0.00 0.00 0.00 0.00 51.96 51.96 2i9y s ALA 94 Cb 0.08 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.10 2i9y s ALA 94 CO 0.48 -0.19 0.26 0.54 0.00 0.00 0.00 175.76 176.85 2i9y s VAL 95 N -0.74 -0.00 -0.26 0.00 0.11 -1.26 0.30 120.40 118.55 2i9y s VAL 95 Ca -0.08 0.02 -0.01 0.00 -2.93 0.00 0.00 61.98 58.98 2i9y s VAL 95 Cb -0.04 -0.38 0.08 0.00 -1.53 0.00 0.00 36.38 34.51 2i9y s VAL 95 CO 0.02 0.01 0.03 -0.70 -3.33 0.00 0.00 175.10 171.13 2i9y s GLU 96 N 0.26 1.01 0.41 1.54 2.56 0.02 -4.98 118.70 119.53 2i9y s GLU 96 Ca -0.01 -0.91 0.15 0.00 0.00 0.00 0.00 54.97 54.20 2i9y s GLU 96 Cb -0.03 -2.28 0.89 0.00 2.00 0.00 0.00 34.13 34.71 2i9y s GLU 96 CO -0.01 -0.77 1.91 -1.35 -0.56 0.00 0.00 175.26 174.49 2i9y h PRO 97 N 8.06 0.00 0.01 4.30 0.11 -1.97 0.63 132.00 143.15 2i9y h PRO 97 Ca -0.15 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.74 2i9y h PRO 97 Cb 1.06 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2i9y h PRO 97 CO 0.42 0.27 -0.94 -0.44 -0.21 0.00 0.00 178.00 177.10 2i9y h ASP 98 N 0.00 0.37 0.06 -2.05 3.32 -1.94 -3.17 116.42 113.01 2i9y h ASP 98 Ca -0.00 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.74 2i9y h ASP 98 Cb 0.50 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2i9y h ASP 98 CO 0.04 1.13 -0.30 0.29 -1.72 0.00 0.00 179.24 178.67 2i9y n LYS 99 N -3.67 1.30 -3.56 3.56 5.02 -1.12 -4.94 118.16 114.75 2i9y n LYS 99 Ca -0.05 -0.98 -0.20 0.00 -2.02 0.00 0.00 58.31 55.06 2i9y n LYS 99 Cb 0.84 -1.48 0.06 0.00 -0.02 0.00 0.00 35.03 34.43 2i9y n LYS 99 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2i9y n ASN 100 N 0.01 -2.30 -4.35 4.39 5.15 -0.32 -4.71 115.26 113.12 2i9y n ASN 100 Ca 0.12 -0.76 -0.31 0.00 -0.60 0.00 0.00 54.58 53.03 2i9y n ASN 100 Cb 0.44 -4.48 -0.15 0.00 -0.53 0.00 0.00 39.78 35.06 2i9y n ASN 100 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2i9y s LEU 101 N -6.42 2.22 -0.12 1.20 2.96 0.06 -2.88 118.68 115.70 2i9y s LEU 101 Ca 0.08 -0.46 -0.05 0.00 -0.22 0.00 0.00 54.13 53.48 2i9y s LEU 101 Cb -0.02 -1.37 0.06 0.00 0.50 0.00 0.00 46.19 45.36 2i9y s LEU 101 CO 0.78 0.30 0.27 -0.51 -1.32 0.00 0.00 176.35 175.88 2i9y s ILE 102 N -0.70 -0.22 -0.24 6.68 1.10 -0.54 -0.80 121.20 126.48 2i9y s ILE 102 Ca 0.11 0.20 -0.08 0.00 -0.51 0.00 0.00 60.65 60.37 2i9y s ILE 102 Cb -0.10 -0.44 -0.04 0.00 0.15 0.00 0.00 42.46 42.04 2i9y s ILE 102 CO 0.00 0.08 0.10 -0.89 -2.11 0.00 0.00 174.94 172.12 2i9y s THR 103 N 1.82 4.63 -0.12 4.00 2.01 0.15 -0.89 115.64 127.23 2i9y s THR 103 Ca -0.05 -0.07 -0.04 0.00 0.31 0.00 0.00 61.69 61.85 2i9y s THR 103 Cb -0.11 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.21 2i9y s THR 103 CO -0.09 0.34 0.03 -0.36 -0.69 0.00 0.00 174.62 173.85 2i9y s PHE 104 N 1.41 3.23 -0.23 4.92 0.08 0.11 -0.25 117.98 127.25 2i9y s PHE 104 Ca 0.06 0.16 -0.05 0.00 0.12 0.00 0.00 56.93 57.22 2i9y s PHE 104 Cb -0.15 -1.89 -0.02 0.00 -0.57 0.00 0.00 43.02 40.39 2i9y s PHE 104 CO 0.05 0.38 0.01 0.50 -0.10 0.00 0.00 175.22 176.06 2i9y s ARG 105 N -0.49 3.51 -0.17 0.44 3.52 0.11 -0.91 118.95 124.95 2i9y s ARG 105 Ca 0.09 -0.55 -0.28 0.00 -0.13 0.00 0.00 55.73 54.86 2i9y s ARG 105 Cb -0.12 -3.15 -0.00 0.00 -1.56 0.00 0.00 34.95 30.11 2i9y s ARG 105 CO 0.02 -0.19 0.96 0.08 -0.81 0.00 0.00 175.30 175.37 2i9y s VAL 106 N 1.53 4.78 -0.23 7.11 1.01 -0.48 0.19 120.40 134.31 2i9y s VAL 106 Ca 0.06 1.91 -0.16 0.00 0.00 0.00 0.00 61.98 63.79 2i9y s VAL 106 Cb -0.15 -4.26 -0.17 0.00 0.00 0.00 0.00 36.38 31.81 2i9y s VAL 106 CO -0.00 -0.06 -0.03 2.30 0.00 0.00 0.00 175.10 177.32 2i9y n ILE 107 N 4.90 1.55 0.00 2.22 -0.00 -1.24 -4.51 119.36 122.28 2i9y n ILE 107 Ca 0.09 -0.26 0.00 0.00 -0.00 0.00 0.00 62.75 62.58 2i9y n ILE 107 Cb 0.48 -1.91 0.00 0.00 -0.00 0.00 0.00 39.64 38.21 2i9y n ILE 107 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 2i9y n GLU 108 N -4.20 0.00 0.00 6.28 4.07 -1.26 -4.69 120.64 120.84 2i9y n GLU 108 Ca -0.42 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.68 2i9y n GLU 108 Cb 0.82 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 32.20 2i9y n GLU 108 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2i9y n GLY 109 N 0.00 3.31 0.09 8.31 0.00 -1.26 -4.87 105.19 110.77 2i9y n GLY 109 Ca 0.00 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 2i9y n GLY 109 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2i9y h ASP 110 N 0.00 0.19 0.51 1.61 3.58 -2.00 -2.63 116.42 117.68 2i9y h ASP 110 Ca 0.00 -0.40 -0.04 0.00 0.42 0.00 0.00 57.03 57.01 2i9y h ASP 110 Cb 0.00 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 2i9y h ASP 110 CO 0.00 0.55 -0.17 -0.07 -2.88 0.00 0.00 179.24 176.67 2i9y h LEU 111 N -0.17 0.00 0.00 2.28 3.38 -1.90 -1.76 115.31 117.13 2i9y h LEU 111 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2i9y h LEU 111 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2i9y h LEU 111 CO 0.01 0.17 0.00 0.23 0.09 0.00 0.00 178.44 178.94 2i9y n MET 112 N -3.61 0.30 0.23 1.13 2.81 -1.01 -1.38 117.12 115.59 2i9y n MET 112 Ca -0.01 0.09 0.12 0.00 -1.81 0.00 0.00 57.70 56.09 2i9y n MET 112 Cb 0.30 -1.50 0.48 0.00 -0.71 0.00 0.00 33.22 31.79 2i9y n MET 112 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2i9y h LYS 113 N 0.00 0.00 0.00 0.03 1.79 -1.10 -3.35 116.57 113.94 2i9y h LYS 113 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2i9y h LYS 113 Cb 0.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2i9y h LYS 113 CO 0.00 0.16 -0.77 -1.91 -1.08 0.00 0.00 179.45 175.85 2i9y n GLU 114 N -3.28 1.21 -3.61 3.15 4.07 -1.16 -4.91 120.64 116.12 2i9y n GLU 114 Ca 0.01 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.73 2i9y n GLU 114 Cb 0.42 -0.89 -0.10 0.00 -0.06 0.00 0.00 31.44 30.81 2i9y n GLU 114 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 2i9y s TYR 115 N -1.77 3.26 -1.28 4.31 2.02 -0.48 0.40 117.35 123.81 2i9y s TYR 115 Ca 0.00 0.18 0.30 0.00 -0.37 0.00 0.00 57.07 57.17 2i9y s TYR 115 Cb 0.00 -2.34 1.38 0.00 -0.40 0.00 0.00 41.96 40.60 2i9y s TYR 115 CO 0.00 -0.07 1.98 0.36 -1.57 0.00 0.00 175.55 176.25 2i9y n LYS 116 N 4.75 0.28 -3.64 -0.62 2.85 -0.43 -3.69 118.16 117.67 2i9y n LYS 116 Ca -0.14 -0.01 -0.11 0.00 -1.05 0.00 0.00 58.31 57.00 2i9y n LYS 116 Cb 0.52 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.33 2i9y n LYS 116 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2i9y s SER 117 N -2.73 -0.63 -0.22 -5.58 0.15 -1.25 -5.01 113.70 98.43 2i9y s SER 117 Ca 0.23 1.18 -0.04 0.00 0.70 0.00 0.00 55.95 58.02 2i9y s SER 117 Cb 0.20 1.20 0.09 0.00 -1.71 0.00 0.00 66.02 65.80 2i9y s SER 117 CO 0.49 -0.20 0.19 0.12 1.20 0.00 0.00 173.24 175.04 2i9y s PHE 118 N 0.50 -0.11 -0.12 3.44 5.36 -1.26 -1.96 117.98 123.83 2i9y s PHE 118 Ca -0.00 -0.11 0.02 0.00 -0.96 0.00 0.00 56.93 55.88 2i9y s PHE 118 Cb -0.05 -0.52 -0.01 0.00 -0.34 0.00 0.00 43.02 42.10 2i9y s PHE 118 CO -0.05 -0.66 -0.17 -1.17 -1.46 0.00 0.00 175.22 171.71 2i9y s LEU 119 N 2.26 2.46 -0.05 6.12 2.96 0.63 -1.37 118.68 131.68 2i9y s LEU 119 Ca 0.06 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 2i9y s LEU 119 Cb -0.16 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.02 2i9y s LEU 119 CO -0.18 0.16 -0.06 -1.48 -1.32 0.00 0.00 176.35 173.47 2i9y s LEU 120 N 0.36 1.38 -0.12 -0.68 2.34 -0.09 -0.09 118.68 121.78 2i9y s LEU 120 Ca -0.14 -0.16 0.01 0.00 0.06 0.00 0.00 54.13 53.90 2i9y s LEU 120 Cb -0.17 -0.52 -0.01 0.00 -0.56 0.00 0.00 46.19 44.93 2i9y s LEU 120 CO 0.07 -0.04 -0.16 -0.89 -1.06 0.00 0.00 176.35 174.27 2i9y s THR 121 N 0.88 2.76 0.05 5.48 2.01 0.47 0.09 115.64 127.39 2i9y s THR 121 Ca -0.12 -0.76 0.09 0.00 0.31 0.00 0.00 61.69 61.21 2i9y s THR 121 Cb -0.15 -2.14 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 2i9y s THR 121 CO 0.01 0.53 -0.25 0.27 -0.69 0.00 0.00 174.62 174.49 2i9y s ILE 122 N 0.39 2.02 -0.01 1.82 -4.36 -0.07 -0.31 121.20 120.66 2i9y s ILE 122 Ca -0.13 -1.36 -0.00 0.00 -0.26 0.00 0.00 60.65 58.90 2i9y s ILE 122 Cb -0.16 -1.73 0.02 0.00 1.25 0.00 0.00 42.46 41.83 2i9y s ILE 122 CO 0.06 0.30 0.03 -1.58 0.24 0.00 0.00 174.94 173.99 2i9y s GLN 123 N -1.28 -0.01 -0.28 0.37 0.74 -0.95 -1.47 119.66 116.79 2i9y s GLN 123 Ca 0.11 0.12 -0.15 0.00 0.05 0.00 0.00 55.36 55.48 2i9y s GLN 123 Cb -0.10 -0.14 -0.03 0.00 1.10 0.00 0.00 33.01 33.84 2i9y s GLN 123 CO 0.02 -0.10 0.39 0.08 -0.55 0.00 0.00 175.29 175.14 2i9y s VAL 124 N 0.62 5.16 -0.07 1.34 1.01 -1.14 -0.52 120.40 126.80 2i9y s VAL 124 Ca -0.05 0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.53 2i9y s VAL 124 Cb -0.07 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 2i9y s VAL 124 CO -0.02 0.11 -0.24 -0.89 0.00 0.00 0.00 175.10 174.06 2i9y s THR 125 N 2.11 2.04 0.68 3.92 2.01 0.68 -4.90 115.64 122.17 2i9y s THR 125 Ca 0.15 -1.04 -0.17 0.00 0.31 0.00 0.00 61.69 60.95 2i9y s THR 125 Cb -0.16 -1.74 -0.01 0.00 0.01 0.00 0.00 72.50 70.61 2i9y s THR 125 CO 0.10 0.56 1.04 -0.81 -0.69 0.00 0.00 174.62 174.83 2i9y n PRO 126 N 3.14 0.70 -2.67 4.92 -0.04 -1.26 0.43 135.00 140.21 2i9y n PRO 126 Ca -0.18 0.29 -0.39 0.00 -0.04 0.00 0.00 63.50 63.19 2i9y n PRO 126 Cb 0.52 -2.28 -0.05 0.00 -0.04 0.00 0.00 33.50 31.64 2i9y n PRO 126 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2i9y s LYS 127 N -3.25 4.64 -0.63 0.54 1.02 -0.99 -4.56 119.74 116.51 2i9y s LYS 127 Ca 0.76 1.52 -0.27 0.00 0.02 0.00 0.00 55.97 58.00 2i9y s LYS 127 Cb -0.37 -3.03 -0.00 0.00 -0.52 0.00 0.00 37.83 33.91 2i9y s LYS 127 CO 0.47 0.30 1.64 -1.25 -0.92 0.00 0.00 175.35 175.59 2i9y s PRO 128 N -1.65 2.89 -0.75 -1.68 0.04 -1.26 -3.44 135.00 129.15 2i9y s PRO 128 Ca 0.46 0.37 -0.01 0.00 0.04 0.00 0.00 61.00 61.86 2i9y s PRO 128 Cb -0.25 -4.29 -0.01 0.00 0.04 0.00 0.00 34.50 29.99 2i9y s PRO 128 CO 0.31 -2.44 0.63 0.41 0.04 0.00 0.00 177.00 175.95 2i9y n GLY 129 N 5.55 -0.18 3.64 0.56 0.00 -1.26 -5.04 105.19 108.46 2i9y n GLY 129 Ca 0.14 0.01 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 2i9y n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i9y s GLY 130 N -3.70 -0.22 -0.29 -0.02 0.00 -1.22 -5.12 107.32 96.76 2i9y s GLY 130 Ca 0.09 2.66 -0.29 0.00 0.00 0.00 0.00 44.72 47.17 2i9y s GLY 130 CO 0.47 2.01 1.56 2.56 0.00 0.00 0.00 173.10 179.71 2i9y s PRO 131 N 0.57 3.69 0.00 2.90 0.04 -1.26 -4.16 135.00 136.78 2i9y s PRO 131 Ca -0.01 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.46 2i9y s PRO 131 Cb -0.05 -4.04 0.00 0.00 0.04 0.00 0.00 34.50 30.45 2i9y s PRO 131 CO -0.08 -1.42 0.00 0.41 0.04 0.00 0.00 177.00 175.95 2i9y n GLY 132 N 4.82 0.84 3.37 0.56 0.00 -1.26 -4.79 105.19 108.73 2i9y n GLY 132 Ca 0.18 -2.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.10 2i9y n GLY 132 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i9y s SER 133 N -4.00 -0.06 -0.15 1.61 1.04 -0.38 -2.34 113.70 109.43 2i9y s SER 133 Ca 0.00 -0.68 -0.03 0.00 0.48 0.00 0.00 55.95 55.72 2i9y s SER 133 Cb 0.00 0.47 -0.03 0.00 0.10 0.00 0.00 66.02 66.56 2i9y s SER 133 CO 0.00 -0.92 -0.05 -0.63 0.98 0.00 0.00 173.24 172.62 2i9y s ILE 134 N -3.91 3.78 -0.30 -1.02 1.09 0.17 -0.14 121.20 120.87 2i9y s ILE 134 Ca 0.12 -0.40 -0.15 0.00 -1.10 0.00 0.00 60.65 59.12 2i9y s ILE 134 Cb 0.02 -2.65 -0.03 0.00 -1.06 0.00 0.00 42.46 38.75 2i9y s ILE 134 CO -0.03 0.50 0.37 0.54 -0.10 0.00 0.00 174.94 176.22 2i9y s VAL 135 N 0.31 5.16 -0.41 2.92 0.11 0.18 -0.23 120.40 128.44 2i9y s VAL 135 Ca -0.05 0.40 -0.22 0.00 -2.93 0.00 0.00 61.98 59.19 2i9y s VAL 135 Cb -0.14 -3.74 0.02 0.00 -1.53 0.00 0.00 36.38 30.98 2i9y s VAL 135 CO 0.03 0.07 0.72 -1.00 -3.33 0.00 0.00 175.10 171.59 2i9y s HIS 136 N 2.07 3.06 -0.23 1.54 3.76 0.32 -1.66 115.29 124.16 2i9y s HIS 136 Ca 0.14 0.23 -0.16 0.00 -0.15 0.00 0.00 55.06 55.12 2i9y s HIS 136 Cb -0.16 -3.43 -0.04 0.00 1.11 0.00 0.00 32.58 30.06 2i9y s HIS 136 CO 0.11 -0.84 0.40 -1.58 -0.85 0.00 0.00 174.74 171.98 2i9y s TRP 137 N 3.03 3.32 -0.27 1.40 0.52 0.82 -2.23 118.94 125.53 2i9y s TRP 137 Ca 0.27 0.54 -0.00 0.00 0.02 0.00 0.00 56.10 56.93 2i9y s TRP 137 Cb -0.13 -2.56 0.04 0.00 -1.15 0.00 0.00 33.47 29.68 2i9y s TRP 137 CO 0.19 -0.11 -0.06 -1.01 0.02 0.00 0.00 176.95 175.98 2i9y s HIS 138 N 1.67 3.19 -0.21 -1.98 3.76 0.57 -1.54 115.29 120.76 2i9y s HIS 138 Ca 0.18 -1.90 -0.06 0.00 -0.15 0.00 0.00 55.06 53.13 2i9y s HIS 138 Cb -0.15 -2.04 -0.03 0.00 1.11 0.00 0.00 32.58 31.48 2i9y s HIS 138 CO 0.09 -0.81 0.02 -0.51 -0.85 0.00 0.00 174.74 172.68 2i9y s LEU 139 N 1.23 3.34 -0.07 0.89 1.02 0.92 -0.39 118.68 125.62 2i9y s LEU 139 Ca -0.04 -0.17 0.02 0.00 0.02 0.00 0.00 54.13 53.95 2i9y s LEU 139 Cb -0.19 -1.85 0.02 0.00 0.02 0.00 0.00 46.19 44.19 2i9y s LEU 139 CO -0.04 0.06 -0.11 -1.61 0.02 0.00 0.00 176.35 174.68 2i9y s GLU 140 N 1.02 1.61 0.19 1.70 2.02 0.87 0.03 118.70 126.14 2i9y s GLU 140 Ca 0.02 -0.36 -0.14 0.00 0.02 0.00 0.00 54.97 54.51 2i9y s GLU 140 Cb -0.14 -1.41 0.01 0.00 0.10 0.00 0.00 34.13 32.69 2i9y s GLU 140 CO 0.02 -0.04 0.43 1.52 0.02 0.00 0.00 175.26 177.21 2i9y s TYR 141 N 0.90 0.10 -0.06 1.61 1.13 0.97 -0.27 117.35 121.73 2i9y s TYR 141 Ca -0.10 -0.46 -0.00 0.00 -1.41 0.00 0.00 57.07 55.10 2i9y s TYR 141 Cb -0.15 0.22 0.03 0.00 -1.10 0.00 0.00 41.96 40.95 2i9y s TYR 141 CO 0.01 -0.85 -0.03 -2.00 -2.51 0.00 0.00 175.55 170.17 2i9y s GLU 142 N -3.92 0.79 0.21 -3.49 2.12 -0.83 0.03 118.70 113.62 2i9y s GLU 142 Ca 0.13 -0.02 -0.30 0.00 0.36 0.00 0.00 54.97 55.14 2i9y s GLU 142 Cb 0.01 -0.98 -0.08 0.00 0.26 0.00 0.00 34.13 33.33 2i9y s GLU 142 CO -0.01 -0.21 1.02 0.15 -0.54 0.00 0.00 175.26 175.67 2i9y s LYS 143 N 1.52 4.72 -0.05 4.30 3.01 0.11 -1.31 119.74 132.03 2i9y s LYS 143 Ca -0.02 1.61 -0.23 0.00 -1.01 0.00 0.00 55.97 56.32 2i9y s LYS 143 Cb -0.13 -3.28 -0.26 0.00 -1.01 0.00 0.00 37.83 33.15 2i9y s LYS 143 CO -0.03 0.29 0.97 0.82 0.51 0.00 0.00 175.35 177.90 2i9y h ILE 144 N 3.44 1.55 0.00 2.17 2.04 -0.39 -3.46 117.51 122.86 2i9y h ILE 144 Ca -0.45 -2.19 0.00 0.00 1.00 0.00 0.00 64.86 63.23 2i9y h ILE 144 Cb 1.21 2.94 0.00 0.00 -0.74 0.00 0.00 36.82 40.23 2i9y h ILE 144 CO 0.70 0.61 0.00 -0.24 0.00 0.00 0.00 178.15 179.21 2i9y n SER 145 N -4.36 0.00 0.00 1.72 2.88 -1.26 -5.09 113.62 107.51 2i9y n SER 145 Ca -0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 2i9y n SER 145 Cb 0.62 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 2i9y n SER 145 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2i9y n GLU 146 N -1.28 0.00 0.22 -1.46 2.13 -1.26 -4.99 120.64 114.00 2i9y n GLU 146 Ca 0.00 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.89 2i9y n GLU 146 Cb 0.00 0.00 0.58 0.00 0.27 0.00 0.00 31.44 32.29 2i9y n GLU 146 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2i9y h GLU 147 N 0.00 0.07 -0.01 5.31 4.81 -1.99 -1.72 114.58 121.05 2i9y h GLU 147 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2i9y h GLU 147 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2i9y h GLU 147 CO 0.00 0.09 -0.42 0.28 -0.73 0.00 0.00 179.01 178.23 2i9y n VAL 148 N -4.47 0.00 -2.63 0.32 0.31 -1.26 -4.92 118.33 105.68 2i9y n VAL 148 Ca -0.02 -0.14 -0.41 0.00 -0.01 0.00 0.00 64.34 63.77 2i9y n VAL 148 Cb 0.13 0.68 -0.05 0.00 -0.91 0.00 0.00 33.84 33.69 2i9y n VAL 148 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2i9y s ALA 149 N -2.61 3.33 -0.37 3.52 0.00 -0.65 -4.77 121.76 120.21 2i9y s ALA 149 Ca 0.19 0.70 0.02 0.00 0.00 0.00 0.00 51.96 52.88 2i9y s ALA 149 Cb 0.18 -3.30 0.15 0.00 0.00 0.00 0.00 23.12 20.16 2i9y s ALA 149 CO 0.59 -0.07 0.33 -1.01 0.00 0.00 0.00 175.76 175.61 2i9y s HIS 150 N -0.40 0.06 0.54 0.00 3.76 -1.26 -4.98 115.29 113.01 2i9y s HIS 150 Ca 0.47 -1.15 0.38 0.00 -0.15 0.00 0.00 55.06 54.61 2i9y s HIS 150 Cb -0.27 -0.57 2.07 0.00 1.11 0.00 0.00 32.58 34.92 2i9y s HIS 150 CO 0.33 -0.93 2.16 -1.35 -0.85 0.00 0.00 174.74 174.11 2i9y h PRO 151 N 6.93 0.00 -0.47 8.40 0.11 -2.00 -2.77 132.00 142.20 2i9y h PRO 151 Ca 0.07 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.26 2i9y h PRO 151 Cb 1.02 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.07 2i9y h PRO 151 CO 0.22 0.00 0.07 0.93 -0.21 0.00 0.00 178.00 179.01 2i9y h GLU 152 N 0.00 0.19 0.02 1.05 5.08 -1.99 -0.59 114.58 118.34 2i9y h GLU 152 Ca 0.00 -0.01 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 2i9y h GLU 152 Cb 0.15 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2i9y h GLU 152 CO 0.00 0.13 -1.09 1.79 -1.00 0.00 0.00 179.01 178.84 2i9y h THR 153 N 0.20 1.62 -0.63 1.13 1.35 -1.92 -2.27 112.91 112.39 2i9y h THR 153 Ca 0.23 -3.32 -0.04 0.00 -0.55 0.00 0.00 66.41 62.73 2i9y h THR 153 Cb 0.31 2.83 -0.03 0.00 -1.73 0.00 0.00 68.15 69.54 2i9y h THR 153 CO -0.32 0.93 0.24 -0.07 -0.25 0.00 0.00 175.52 176.05 2i9y h LEU 154 N 0.01 0.88 -0.71 3.87 3.38 -1.42 0.26 115.31 121.59 2i9y h LEU 154 Ca -0.05 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 2i9y h LEU 154 Cb 1.82 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.33 2i9y h LEU 154 CO 0.14 0.82 -0.45 -0.07 0.09 0.00 0.00 178.44 178.96 2i9y h LEU 155 N 0.89 0.48 -0.75 1.67 3.38 -1.04 -1.81 115.31 118.12 2i9y h LEU 155 Ca 0.21 -0.23 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2i9y h LEU 155 Cb 0.23 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2i9y h LEU 155 CO -0.01 0.87 -0.58 1.56 0.09 0.00 0.00 178.44 180.36 2i9y h GLN 156 N 0.36 0.14 -0.67 1.13 4.20 -0.97 0.89 115.11 120.20 2i9y h GLN 156 Ca 0.02 -0.09 0.05 0.00 0.06 0.00 0.00 58.65 58.69 2i9y h GLN 156 Cb 0.94 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.68 2i9y h GLN 156 CO 0.08 0.68 0.38 0.35 -0.67 0.00 0.00 178.83 179.65 2i9y h PHE 157 N 0.11 0.70 0.04 2.96 3.57 -0.20 0.84 116.94 124.97 2i9y h PHE 157 Ca -0.00 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 2i9y h PHE 157 Cb 1.06 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.58 2i9y h PHE 157 CO 0.01 0.36 -0.02 0.00 -2.23 0.00 0.00 178.31 176.43 2i9y h VAL 159 N -0.09 0.75 -0.19 0.00 2.07 -0.15 0.88 116.25 119.52 2i9y h VAL 159 Ca -0.01 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 2i9y h VAL 159 Cb 0.08 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2i9y h VAL 159 CO 0.01 0.00 -0.35 -0.33 0.02 0.00 0.00 177.57 176.92 2i9y h GLU 160 N -0.06 0.39 -0.34 1.57 4.39 -0.86 -1.39 114.58 118.28 2i9y h GLU 160 Ca 0.09 -0.17 -0.13 0.00 0.34 0.00 0.00 59.36 59.49 2i9y h GLU 160 Cb 0.19 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2i9y h GLU 160 CO -0.20 0.70 -0.30 0.28 -1.16 0.00 0.00 179.01 178.32 2i9y h VAL 161 N 0.34 1.29 -0.99 3.13 2.07 -1.21 -3.02 116.25 117.85 2i9y h VAL 161 Ca 0.04 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.11 2i9y h VAL 161 Cb 0.78 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 2i9y h VAL 161 CO 0.06 0.48 0.65 0.28 0.02 0.00 0.00 177.57 179.07 2i9y h SER 162 N 0.58 1.12 -0.80 0.57 0.02 -0.19 -0.46 113.55 114.39 2i9y h SER 162 Ca 0.06 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2i9y h SER 162 Cb 0.88 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 63.11 2i9y h SER 162 CO 0.08 0.79 0.39 0.11 -1.14 0.00 0.00 176.83 177.06 2i9y h LYS 163 N 1.31 1.16 0.00 3.45 1.57 -1.25 -1.57 116.57 121.24 2i9y h LYS 163 Ca 0.37 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2i9y h LYS 163 Cb -0.10 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.00 2i9y h LYS 163 CO -0.09 0.89 -0.13 1.49 -0.57 0.00 0.00 179.45 181.03 2i9y h GLU 164 N 1.15 0.09 -0.55 3.15 4.81 -1.21 -3.10 114.58 118.92 2i9y h GLU 164 Ca 0.28 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2i9y h GLU 164 Cb 0.11 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2i9y h GLU 164 CO -0.04 0.87 0.32 0.97 -0.73 0.00 0.00 179.01 180.41 2i9y h ILE 165 N -0.66 1.16 -0.15 2.32 -0.00 -1.11 0.27 117.51 119.34 2i9y h ILE 165 Ca -0.02 -0.37 0.04 0.00 -0.00 0.00 0.00 64.86 64.51 2i9y h ILE 165 Cb 0.92 0.39 -0.05 0.00 -0.00 0.00 0.00 36.82 38.08 2i9y h ILE 165 CO 0.03 0.17 -0.15 -0.78 -0.00 0.00 0.00 178.15 177.42 2i9y h ASP 166 N 0.76 -0.47 0.62 2.19 3.58 -1.33 -2.65 116.42 119.11 2i9y h ASP 166 Ca 0.20 0.09 -0.17 0.00 0.42 0.00 0.00 57.03 57.57 2i9y h ASP 166 Cb -0.01 0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.25 2i9y h ASP 166 CO -0.04 -0.19 -0.79 -0.33 -2.88 0.00 0.00 179.24 175.01 2i9y h GLU 167 N -0.18 0.12 -0.73 0.28 5.08 -1.22 -3.26 114.58 114.68 2i9y h GLU 167 Ca 0.10 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2i9y h GLU 167 Cb 0.32 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 2i9y h GLU 167 CO -0.26 0.85 0.48 1.25 -1.00 0.00 0.00 179.01 180.33 2i9y h HIS 168 N 0.08 0.84 0.00 4.33 2.76 -0.16 0.18 115.15 123.18 2i9y h HIS 168 Ca -0.02 0.02 -0.16 0.00 -2.20 0.00 0.00 60.37 58.01 2i9y h HIS 168 Cb 1.38 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 30.04 2i9y h HIS 168 CO 0.02 0.47 -0.75 -0.07 -1.30 0.00 0.00 177.93 176.30 2i9y h LEU 169 N 0.85 0.00 -0.35 0.26 -0.00 -1.57 -3.11 115.31 111.38 2i9y h LEU 169 Ca 0.30 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 58.15 2i9y h LEU 169 Cb 0.12 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.77 2i9y h LEU 169 CO -0.09 0.75 -0.14 -0.07 -0.00 0.00 0.00 178.44 178.89 2i9y h LEU 170 N 0.00 0.00 -8.59 1.67 3.38 -1.09 -3.39 115.31 107.28 2i9y h LEU 170 Ca -0.01 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.36 2i9y h LEU 170 Cb 1.41 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.05 2i9y h LEU 170 CO 0.10 0.14 0.61 0.00 0.09 0.00 0.00 178.44 179.38 2i9y s ALA 171 N -3.28 3.19 0.40 1.53 0.00 0.46 -5.03 121.76 119.04 2i9y s ALA 171 Ca 0.05 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 2i9y s ALA 171 Cb 0.07 -3.71 -0.06 0.00 0.00 0.00 0.00 23.12 19.42 2i9y s ALA 171 CO 0.66 -2.23 0.73 -1.83 0.00 0.00 0.00 175.76 173.09 2i9y s GLU 172 N 3.94 3.70 0.00 0.00 -1.05 -1.26 -4.88 118.70 119.15 2i9y s GLU 172 Ca 0.35 0.33 0.31 0.00 -0.15 0.00 0.00 54.97 55.82 2i9y s GLU 172 Cb -0.11 -2.43 1.76 0.00 -0.44 0.00 0.00 34.13 32.91 2i9y s GLU 172 CO 0.24 -0.03 2.15 0.39 0.95 0.00 0.00 175.26 178.96